4-nitro-2-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenolate

Systemtic Name: 4-nitro-2-[(E)-(4-oxidanylidene-2-phenylazanyl-1,3-thiazol-5-ylidene)methyl]phenolate Openeye Name: 2-[(E)-(2-anilino-4-oxo-thiazol-5-ylidene)methyl]-4-nitro-phenolate CAS Name: 2-[(E)-(2-anilino-4-oxo-5-thiazolylidene)methyl]-4-nitrophenolate IUPAC Name: 2-[(E)-(2-anilino-4-oxo-1,3-thiazol-5-ylidene)methyl]-4-nitrophenolate Traditional Name: 2-[(E)-(2-anilino-4-keto-2-thiazolin-5-ylidene)methyl]-4-nitro-phenolate Formula: C16H10N3O4S- MolecularWeight: 340.3333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])S2

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=C(C=CC(=C3)[N+](=O)[O-])[O-])/S2

InChI

InChI=1S/C16H11N3O4S/c20-13-7-6-12(19(22)23)8-10(13)9-14-15(21)18-16(24-14)17-11-4-2-1-3-5-11/h1-9,20H,(H,17,18,21)/p-1/b14-9+